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angiotensin-(1-7)

Properties

Image

Occurences in reactions

MNX_ID

MNXM5180

	#reac
in my sandbox	0
in MNXref (generic)	4
in models (compartimentalized)	1

formula

C₄₁H₆₂N₁₂O₁₁

charge

mass

898.4661

reference

chebi:58922

InChIKey

PVHLMTREZMEJCG-GDTLVBQBSA-N

InChI

InChI=1S/C41H62N12O11/c1-5-22(4)33(38(61)50-29(17-24-19-45-20-47-24)39(62)53-15-7-9-30(53)40(63)64)52-36(59)28(16-23-10-12-25(54)13-11-23)49-37(60)32(21(2)3)51-35(58)27(8-6-14-46-41(43)44)48-34(57)26(42)18-31(55)56/h10-13,19-22,26-30,32-33,54H,5-9,14-18,42H2,1-4H3,(H,45,47)(H,48,57)(H,49,60)(H,50,61)(H,51,58)(H,52,59)(H,55,56)(H,63,64)(H4,43,44,46)/t22-,26-,27-,28-,29-,30-,32-,33-/m0/s1

SMILES

CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](NC(=O)[C@H](CCCNC(N)=[NH2+])NC(=O)[C@@H]([NH3+])CC(=O)[O-])C(C)C)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N1CCC[C@H]1C(=O)[O-]

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:58922 chebi:58922	angiotensin-(1-7) Ile(5)-angiotensin II (1-7) dizwitterion
kegg.compound:C15850 keggC:C15850	Angiotensin (1-7)
seed.compound:cpd14581 seedM:cpd14581	Angiotensin (1-7) angiotensin-(1-7)
sabiork.compound:28358 sabiorkM:28358	Angiotensin-(1-7) DRVYIHP
CHEBI:55438 chebi:55438	Ile(5)-angiotensin II (1-7) 8-Des-phe-angiotensin II Angiotensin (1-7) Angiotensin I (1-7) Angiotensin II (1-7) Angiotensin II (1-7) heptapeptide L-alpha-aspartyl-L-arginyl-L-valyl-L-tyrosyl-L-isoleucyl-L-histidyl-L-proline
metacyc.compound:CPD-12083 metacycM:CPD-12083	angiotensin-1-7 Asp-Arg-Val-Tyr-Ile-His-Pro angiotensin-(1-7)
keggC:M_C15850 seedM:M_cpd14581	secondary/obsolete/fantasy identifier